SCHEMBL25527907

SCHEMBL25527907

Bc1cccc(C(=O)OCCS(=O)(=O)O)c1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.42
SERPINE1 P05121 1/20 0.40
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
TSHR P16473 2/20 0.40
KMT2A Q03164 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 1/20 0.38
SLC7A5 Q01650 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL25527919 0.85 SERPINE1 (0.42) TDP1SERPINE1KMT2AALDH1A1
SCHEMBL18776009 0.84 L3MBTL1 (0.50) TDP1KMT2AALDH1A1
SCHEMBL25737047 0.84 SLC7A5 (0.44) TDP1SERPINE1LMNASMN1; SMN2TSHR
SCHEMBL19756044 0.83 TDP1 (0.41) TDP1SERPINE1LMNASMN1; SMN2TSHR
SCHEMBL18775890 0.83 LMNA (0.58) TDP1LMNASMN1; SMN2TSHRKMT2A
SCHEMBL25476176 0.83 L3MBTL1 (0.52) TDP1TSHR
SCHEMBL18775864 0.83 CES2 (0.47) TDP1LMNAKMT2AALDH1A1MEN1
SCHEMBL2608651 0.82 TDP1 (0.63) TDP1LMNASMN1; SMN2TSHRKMT2A
SCHEMBL27600533 0.79 TSHR (0.48) TDP1LMNASMN1; SMN2TSHRALDH1A1
SCHEMBL25527918 0.79 STS (0.40) LMNATSHRALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230152696-A1 POSITIVE RESIST COMPOSITION AND PATTERN FORMING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2023-05-18 US disclosed